N-(2-cyclopentylpyrazol-3-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-cyclopentylpyrazol-3-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]ethanamide Openeye Name: N-(2-cyclopentylpyrazol-3-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]acetamide CAS Name: N-(2-cyclopentyl-3-pyrazolyl)-2-[(3S)-3-(trifluoromethyl)-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(2-cyclopentylpyrazol-3-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]acetamide Traditional Name: N-(2-cyclopentylpyrazol-3-yl)-2-[(3S)-3-(trifluoromethyl)piperidin-1-ium-1-yl]acetamide Formula: C16H24F3N4O+ MolecularWeight: 345.38317

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=CC=N2)NC(=O)C[NH+]3CCCC(C3)C(F)(F)F

Isomeric SMILES

C1CCC(C1)N2C(=CC=N2)NC(=O)C[NH+]3CCC[C@@H](C3)C(F)(F)F

InChI

InChI=1S/C16H23F3N4O/c17-16(18,19)12-4-3-9-22(10-12)11-15(24)21-14-7-8-20-23(14)13-5-1-2-6-13/h7-8,12-13H,1-6,9-11H2,(H,21,24)/p+1/t12-/m0/s1